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Methyl (2S,6R)-6-((8S,10R,13R,14S,17R)-10,13-dimethyl-3-oxo-2,3,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)-2-methylheptanoate

Compound with spectra: 1 MS (GC)

Methyl (2S,6R)-6-((8S,10R,13R,14S,17R)-10,13-dimethyl-3-oxo-2,3,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)-2-methylheptanoate
SpectraBase Compound ID IsWRi4abmEi
InChI InChI=1S/C28H44O3/c1-18(7-6-8-19(2)26(30)31-5)23-11-12-24-22-10-9-20-17-21(29)13-15-27(20,3)25(22)14-16-28(23,24)4/h17-19,22-25H,6-16H2,1-5H3/t18-,19+,22+,23-,24+,25?,27+,28-/m1/s1
InChIKey YCMCZAOYUJSOBD-IJZWQWLDSA-N
Mol Weight 428.7 g/mol
Molecular Formula C28H44O3
Exact Mass 428.329045 g/mol
Enantiomer InChIKey YCMCZAOYUJSOBD-VULIZQHESA-N

View Spectrum of Methyl (2S,6R)-6-((8S,10R,13R,14S,17R)-10,13-dimethyl-3-oxo-2,3,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)-2-methylheptanoate

MS (GC) Spectrum
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Source of Spectrum Parag Mahanti, et al. Cell Metabolism, V.19, 2014, P.73-83
Cholest-4-en-26-oic acid, 3-oxo-, methyl ester
(6R)-6-[(8S,9S,10R,13R,14S,17R)-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]-2-methylheptanoic acid methyl ester
Cholest-4-en-26-oic acid, 3-oxo-
(25R)-26-hydroxycholest-4-en-3-one
26-Hydroxycholest-4-en-3-one
Cholest-4-en-3-one, 26-hydroxy-
(8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methyl-7-oxidanyl-heptan-2-yl]-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
(25R)-26-(Hydroxy)cholest-4-en-3-one 26-acetate
Cholest-4-en-3-one, 26-(acetyloxy)-
26-Acetoxy-cholest-4-en-3-one
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